![4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide structure](/static/products/1022/1022477-55-9.webp)
4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
TL;DR: 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide (CAS 1022477-55-9) is a chemical compound with molecular formula C18H18N4O6S and molecular weight 418.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Also Known As: 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide, 2,2-DIMETHYL-5-(((4-(((4-METHYLPYRIMIDIN-2-YL)AMINO)SULFONYL)PHENYL)AMINO)METHYLENE)-1,3-DIOXANE-4,6-DIONE, C18H18N4O6S
| Molecular Formula | C18H18N4O6S |
|---|---|
| Molecular Weight | 418.09 g/mol |
| LogP | 1.71772 |
| Topological Polar Surface Area | 136.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.0947 |
| Heavy Atoms | 29 |
| Complexity | 1071.5894 |
Chemical Identifiers
| CAS Number | 1022477-55-9 |
|---|---|
| SMILES | CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C(=O)OC(OC3=O)(C)C |
Product Overview
4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide (CAS 1022477-55-9), with molecular formula C18H18N4O6S and molecular weight 418.09 g/mol. IUPAC: 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide.
Chemical Property Profile of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Property Insights of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
The XLogP value of 1.71772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide. The TPSA of 136.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
The CAS number of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide is 1022477-55-9.
What is the molecular formula of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
The molecular formula of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide is C18H18N4O6S.
What is the molecular weight of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
The molecular weight of 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide is 418.09 g/mol.
Where can I buy 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
You can request a quote for 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.